MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03370176

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.

Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
PPN	PARA-NITROPHENYLALANINE	I	1YTJ	0.71
PRY	2-PROPYL-ANILINE	A	1OWY	0.78
3NT	3-NITROTOLUENE	A,B	2BMR	0.84
3NT	3-NITROTOLUENE	A,B	2HMO	0.84
NP2	N-(3-AMINOPROPYL)-2-NITROBENZENAMINE	A	1WUM	0.73
APB	M-AMINOPHENYLBORONIC ACID	A,B	3BLS	0.7
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.74
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.74
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.74
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.74
UA5	(4-ETHYLPHENYL)SULFAMIC ACID	A,B	2I5X	0.79
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.78
NPB	3-NITROPHENYLBORONIC ACID	A,B	1KDS	0.75
150	4,5-DIMETHYL-1,2-PHENYLENEDIAMINE	A	1L4F	0.74
NIN	DINITROPHENYLENE	A	1RSM	0.75
NIN	DINITROPHENYLENE	A	1GVY	0.75
NIN	DINITROPHENYLENE	A	1GW1	0.75
HFT	HYDROXYFLUTAMIDE	A	2AX6	0.74
FLM	3-FLUORO-2-METHYL-ANILINE	A	1OVJ	0.76
TNL	2,4,6-TRINITROTOLUENE	A	1GVR	0.82
BHM	(R)-3-BROMO-2-HYDROXY-2-METHYL- N-[4-NITRO-3-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE	A	2AX9	0.71
NIT	4-NITROANILINE	C,D	1RMH	0.8
NIT	4-NITROANILINE	A,B,D,F,G,H,I	2IXP	0.8
NIT	4-NITROANILINE	B	1VBS	0.8
NIT	4-NITROANILINE	C	1V9T	0.8
NIT	4-NITROANILINE	C,D	1VBT	0.8
NIT	4-NITROANILINE	B	1LOP	0.8
NIT	4-NITROANILINE	C,D	1ZKF	0.8
NIT	4-NITROANILINE	B	1PIP	0.8
PNZ	P-NITRO-BENZYLAMINE	A,D,H	2HJ4	0.85
PNZ	P-NITRO-BENZYLAMINE	A,B	2C70	0.85
4NM	4-NITROPHENYL METHANETHIOL	A,B	2VO4	0.79
NBZ	NITROBENZENE	A,B	2BMQ	0.75
NBZ	NITROBENZENE	A,B	3BGU	0.75
NPP	N-(2-AMINO-ETHYL)-4,6-DINITRO-N'- (2,2,6,6-TETRAMETHYL-1-OXY-PIPERIDIN- 4-YL)-BENZENE-1,3-DIAMINE	L	1BAF	0.7
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.8
PNC	PARA-NITROBENZYL GLUTARYL GLYCINIC ACID	L	1YEF	0.71
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELE	0.71
ANI	4-TRIFLUOROMETHYLANILINE	E,I	7EST	0.71
ANI	4-TRIFLUOROMETHYLANILINE	E,I	2EST	0.71
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELD	0.71
PND	P-NITROPHENYLHYDRAZINE	A,G	1JMZ	0.75
ASR	4-AMINOPHENYLARSONIC ACID	A	1N4F	0.7
34A	3,4-DIMETHYLANILINE	A	1L4K	0.76
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.79
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.79
3CZ	(2R)-1-[(4-tert-butylphenyl)sulfonyl]- 2-methyl-4-(4-nitrophenyl)piperazine	A,B	3CZR	0.7